2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]sulfanyl-N-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]ethanamide

Systemtic Name: 2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]sulfanyl-N-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]ethanamide Openeye Name: 2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]sulfanyl-N-[4-(4-ethylphenyl)thiazol-2-yl]acetamide CAS Name: 2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]thio]-N-[4-(4-ethylphenyl)-2-thiazolyl]acetamide IUPAC Name: 2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]sulfanyl-N-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]acetamide Traditional Name: 2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]thio]-N-[4-(4-ethylphenyl)thiazol-2-yl]acetamide Formula: C24H25N3O2S2 MolecularWeight: 451.6042

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CSCC(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)CSCC(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C24H25N3O2S2/c1-2-17-7-9-19(10-8-17)21-14-31-24(25-21)26-22(28)15-30-16-23(29)27-12-11-18-5-3-4-6-20(18)13-27/h3-10,14H,2,11-13,15-16H2,1H3,(H,25,26,28)